input word = C00019310

Metabolite InformationStructural formula
Name Germanaism C
5,7,3'-Trihydroxy-6,4',5'-trimethoxyisoflavone 7-O-(6''-glucosylglucoside)
Formula C30H36O18
Mw 684.19016435
CAS RN 696663-52-2
C_ID C00019310 ,
InChIKey MMBFBXQUZNSAAJ-IFSIEIBVNA-N
InChICode InChI=1S/C30H36O18/c1-41-14-5-10(4-12(32)27(14)42-2)11-8-44-13-6-15(28(43-3)22(36)18(13)19(11)33)46-30-26(40)24(38)21(35)17(48-30)9-45-29-25(39)23(37)20(34)16(7-31)47-29/h4-6,8,16-17,20-21,23-26,29-32,34-40H,7,9H2,1-3H3/t16-,17-,20-,21-,23+,24+,25-,26-,29-,30-/m1/s1
SMILES COc1cc(-c2coc3cc(O[C@@H]4OC(CO[C@@H]5OC(CO)[C@@H](O)[C@H](O)C5O)[C@@H](O)[C@H](O)C4O)c(OC)c(O)c3c2=O)cc(O)c1OC
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeIridaceaeIris germanica Ref.
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